# CIF generated by HEAS from Alexandria entry agm003242587 data_agm003242587 _cell_length_a 13.24399 _cell_length_b 6.56296 _cell_length_c 12.21600 _cell_angle_alpha 57.84464 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 898.93834 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba1 Ba 0.65281 0.18279 0.61238 1.00000 Ba2 Ba 0.15281 0.81721 0.88762 1.00000 Ba3 Ba 0.34719 0.81721 0.38762 1.00000 Ba4 Ba 0.84719 0.18279 0.11238 1.00000 Ba5 Ba 0.50000 0.00000 0.00000 1.00000 Ba6 Ba 0.00000 0.00000 0.50000 1.00000 P1 P 0.84741 0.04931 0.84825 1.00000 P2 P 0.34741 0.95069 0.65175 1.00000 P3 P 0.15259 0.95069 0.15175 1.00000 P4 P 0.65259 0.04931 0.34825 1.00000 P5 P 0.48736 0.72384 0.68681 1.00000 P6 P 0.98736 0.27616 0.81319 1.00000 P7 P 0.68231 0.61297 0.05376 1.00000 P8 P 0.18231 0.38703 0.44624 1.00000 P9 P 0.31769 0.38703 0.94624 1.00000 P10 P 0.81769 0.61297 0.55376 1.00000 P11 P 0.58784 0.29567 0.14303 1.00000 P12 P 0.08784 0.70433 0.35697 1.00000 P13 P 0.41216 0.70433 0.85697 1.00000 P14 P 0.91216 0.29567 0.64303 1.00000 P15 P 0.71460 0.62490 0.22701 1.00000 P16 P 0.21460 0.37510 0.27299 1.00000 P17 P 0.28540 0.37510 0.77299 1.00000 P18 P 0.78540 0.62490 0.72701 1.00000 P19 P 0.56377 0.58895 0.31376 1.00000 P20 P 0.06377 0.41105 0.18624 1.00000 P21 P 0.43623 0.41105 0.68624 1.00000 P22 P 0.93623 0.58895 0.81376 1.00000 P23 P 0.77578 0.25955 0.35572 1.00000 P24 P 0.27578 0.74045 0.14428 1.00000 P25 P 0.22422 0.74045 0.64428 1.00000 P26 P 0.72422 0.25955 0.85572 1.00000 P27 P 0.01264 0.72384 0.18681 1.00000 P28 P 0.51264 0.27616 0.31319 1.00000